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CALONCOBALACTONE;3,27-DIOXO-30-NORFRIEDELAN-20(29)-EN-27,15-ALPHA-LACTONE
SpectraBase Compound ID 3ONG6WYgWPs
InChI InChI=1S/C29H42O3/c1-17-9-11-25(3)16-23-28(6)21-10-12-26(4)18(2)19(30)7-8-20(26)27(21,5)13-14-29(28,22(25)15-17)24(31)32-23/h18,20-23H,1,7-16H2,2-6H3/t18-,20+,21-,22+,23-,25+,26+,27-,28-,29-/m0/s1
InChIKey VWWIQUPEGPHXDE-ZQGYFWGMSA-N
Mol Weight 438.7 g/mol
Molecular Formula C29H42O3
Exact Mass 438.313395 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5KSj0NB7xYD
Name CALONCOBA-LACTONE;30-NOR-D:A-FRIEDOOLEAN-20(29)-EN-3-ONE-27->15-ALPHA-LACTONE
Compound Number 174
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H42O3
InChI InChI=1S/C29H42O3/c1-17-9-11-25(3)16-23-28(6)21-10-12-26(4)18(2)19(30)7-8-20(26)27(21,5)13-14-29(28,22(25)15-17)24(31)32-23/h18,20-23H,1,7-16H2,2-6H3/t18-,20+,21-,22+,23-,25+,26+,27-,28-,29-/m0/s1
InChIKey VWWIQUPEGPHXDE-ZQGYFWGMSA-N
Literature Reference Author S.B.MAHATO,A.P.KUNDU
Literature Reference Citation PHYTOCHEM.,37,1517(1994)
Literature Reference DOI 10.1016/S0031-9422(00)89569-2
Molecular Weight 438.651 g/mol
Solvent CDCl3
Source File Reference UWMS5274